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Mendeleev Communications, 2002, Volume 12, Issue 5, Pages 173–175
DOI: https://doi.org/10.1070/MC2002v012n05ABEH001645 (Mi mendc4148) 		 
This article is cited in 17 scientific papers (total in 17 papers)

A theoretical DFT study of the mechanism of C–C bond hydrogenolysis in alkanes on silica-supported zirconium hydrides

D. V. Besedin, L. Yu. Ustynyuk, V. V. Lunin

Department of Chemistry, M.V. Lomonosov Moscow State University, Moscow, Russian Federation
Full-text PDF (108 kB) Citations (17)
DOI: https://doi.org/10.1070/MC2002v012n05ABEH001645
Abstract: A DFT study of C–C bond hydrogenolysis in alkanes on silica-supported zirconium monohydrides (≡Si−O)3ZrH and dihydrides (≡Si−O)2ZrH2 shows that only the latter are capable of catalysing this process under mild conditions.
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Document Type: Article
Language: English


Citation: D. V. Besedin, L. Yu. Ustynyuk, V. V. Lunin, “A theoretical DFT study of the mechanism of C–C bond hydrogenolysis in alkanes on silica-supported zirconium hydrides”, Mendeleev Commun., 12:5 (2002), 173–175
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  • https://www.mathnet.ru/eng/mendc/v12/i5/p173
    • This publication is cited in the following 17 articles:
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